SCHEMBL4030132

SCHEMBL4030132

Cc1ncc(-c2ccnc(Nc3ccccc3)n2)n1C1CCC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 14/20 0.68
CDK4 P11802 6/20 0.48
KCNH2 Q12809 2/20 0.48
CCND1 P24385 4/20 0.47
CCND3 P30281 4/20 0.47
CCND2 P30279 3/20 0.47
CCNA2 P20248 2/20 0.47
FGFR1 P11362 1/20 0.47
FGFR2 P21802 1/20 0.47
FGFR4 P22455 1/20 0.47
FGFR3 P22607 1/20 0.47
JAK3 P52333 1/20 0.47
KDR P35968 1/20 0.47
PLK1 P53350 1/20 0.47
PTK2 Q05397 1/20 0.47
ABL1 P00519 1/20 0.47
EGFR P00533 1/20 0.47
PRKCA P17252 1/20 0.47
PRKCD Q05655 1/20 0.47
PIK3C3 Q8NEB9 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4193367 0.98 CDK2 (0.71) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL4025419 0.95 CDK2 (0.64) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL4023119 0.85 CDK2 (0.52) CDK2CDK4CCND1CCND3CCND2
SCHEMBL3549674 0.83 CDK2 (0.69) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL4024196 0.83 CDK2 (0.54) CDK2CDK4CCND1CCND3CCND2
SCHEMBL5105343 0.80 CDK2 (0.69) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL3547575 0.80 KCNH2 (0.73) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL4028905 0.80 CDK2 (0.65) CDK2CDK4KCNH2CCND1CCND3
SCHEMBL1447563 0.80 CDK2 (0.72) CDK2KCNH2CDK1
SCHEMBL4262997 0.80 CDK2 (0.60) CDK2CDK4KCNH2CCND1CCND3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1485375-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2009-06-17 EP disclosed
US-7485638-B2 Pyrimidine compounds ASTRAZENECA AB (SE) 2009-02-03 US disclosed
US-20050256311-A1 Pyrimidine compounds ASTRAZENECA AB (SE) 2005-11-17 US disclosed
EP-1485375-A1 PYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2004-12-15 EP disclosed
WO-2003076435-A1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2003-09-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050256311-A1 Pyrimidine compounds TYMP, TYMS, CCNT1 CDK2 24/4885CDK4 48/4885KCNH2 4329/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.